Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:47:00 UTC |
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Update Date | 2025-03-25 00:49:03 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02171603 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C9H16N2O6 |
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Molecular Mass | 248.1008 |
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SMILES | CN(CCC(N)C(=O)O)C(CC(=O)O)C(=O)O |
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InChI Key | NLUYFEPOCFQKFZ-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | organic acids and derivatives |
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Class | carboxylic acids and derivatives |
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Subclass | amino acids, peptides, and analogues |
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Direct Parent | aspartic acid and derivatives |
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Geometric Descriptor | aliphatic acyclic compounds |
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Alternative Parents | alpha amino acidsamino acidsamino fatty acidscarbonyl compoundscarboxylic acidsfatty acylshydrocarbon derivativesmonoalkylaminesorganic oxidesorganopnictogen compoundstrialkylaminestricarboxylic acids and derivatives |
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Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidamino acidtertiary aliphatic aminetricarboxylic acid or derivativesamino fatty acidorganic oxideorganic oxygen compoundalpha-amino acidaspartic acid or derivativesorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundaminetertiary amineorganooxygen compound |
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